2-(3,4-dihydro-2H-1-benzopyran-6-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

2-(3,4-dihydro-2H-1-benzopyran-6-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

CAS: 1002727-88-9

Formula: C15H21BO3

SMILES: CC1(C)OB(OC1(C)C)C1=CC=C2OCCCC2=C1

IUPAC: 2-(3,4-dihydro-2H-1-benzopyran-6-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

InChI: InChI=1S/C15H21BO3/c1-14(2)15(3,4)19-16(18-14)12-7-8-13-11(10-12)6-5-9-17-13/h7-8,10H,5-6,9H2,1-4H3

Composition: C (69.26%), H (8.14%), B (4.16%), O (18.45%)

Molar Mass: 260.14

Atom Count: 40

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	260.158375
Formal Charge	0
FSP3	0.6
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	NDSHAELUPJMEBM-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	70.09
Topological Polar Surface Area	27.69
Polarizability	29.39
Ring Count	3
Rotatable Bond Count	1

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